4-(2-methoxy-10-methyl-7-oxidanyl-acridin-10-ium-9-yl)carbonyloxy-3,5-dimethyl-benzoic acid

Systemtic Name: 4-(2-methoxy-10-methyl-7-oxidanyl-acridin-10-ium-9-yl)carbonyloxy-3,5-dimethyl-benzoic acid Openeye Name: 4-(2-hydroxy-7-methoxy-10-methyl-acridin-10-ium-9-carbonyl)oxy-3,5-dimethyl-benzoic acid CAS Name: 4-[(2-hydroxy-7-methoxy-10-methyl-9-acridin-10-iumyl)-oxomethoxy]-3,5-dimethylbenzoic acid IUPAC Name: 4-(2-hydroxy-7-methoxy-10-methylacridin-10-ium-9-carbonyl)oxy-3,5-dimethylbenzoic acid Traditional Name: 4-(2-hydroxy-7-methoxy-10-methyl-acridin-10-ium-9-carbonyl)oxy-3,5-dimethyl-benzoic acid Formula: C25H22NO6+ MolecularWeight: 432.44528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C=C(C=C4)OC)C)O)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C=C(C=C4)OC)C)O)C)C(=O)O

InChI

InChI=1S/C25H21NO6/c1-13-9-15(24(28)29)10-14(2)23(13)32-25(30)22-18-11-16(27)5-7-20(18)26(3)21-8-6-17(31-4)12-19(21)22/h5-12H,1-4H3,(H-,27,28,29,30)/p+1